Geometry & MOs

Info

ID:	296146
PubChem CID:	117557986
Reduced:	ON3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	203.105862
ΔH_f, kcal/mol:	14.54
Dipole, Da:	4.82
IP(EA), eV:	-9.57(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-cyanopyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCCN(CC1)C(=O)C2=C(C=CN=C2)C#N

DOS

IR

Vibrations